3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol

C18H20FNO — CID 13469603

IUPAC3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol
SMILESCN1CCC(O)(c2ccccc2)C(c2ccccc2F)C1
InChIInChI=1S/C18H20FNO/c1-20-12-11-18(21,14-7-3-2-4-8-14)16(13-20)15-9-5-6-10-17(15)19/h2-10,16,21H,11-13H2,1H3
InChIKeyOTALMKNOXJZILS-UHFFFAOYSA-N
MW285.36 g/mol
LogP3.13
Rot. Bonds2

About 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol

3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol (PubChem CID 13469603) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol.

Molecular Properties

Compound Name3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol
PubChem CID13469603
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC Name3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol
SMILESCN1CCC(O)(c2ccccc2)C(c2ccccc2F)C1
InChIInChI=1S/C18H20FNO/c1-20-12-11-18(21,14-7-3-2-4-8-14)16(13-20)15-9-5-6-10-17(15)19/h2-10,16,21H,11-13H2,1H3
InChIKeyOTALMKNOXJZILS-UHFFFAOYSA-N
XLogP3.13
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol?
The IUPAC name of 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol (CID 13469603) is 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol.
What is the SMILES notation for 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol?
The canonical SMILES for 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol is CN1CCC(O)(c2ccccc2)C(c2ccccc2F)C1.
What is the InChIKey of 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol?
The InChIKey is OTALMKNOXJZILS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO/c1-20-12-11-18(21,14-7-3-2-4-8-14)16(13-20)15-9-5-6-10-17(15)19/h2-10,16,21H,11-13H2,1H3.
What are the key properties of 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol?
3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol has a molecular weight of 285.36 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-1-methyl-4-phenylpiperidin-4-ol is sourced from PubChem (CID 13469603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).